{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.4496607 2.0219143 1.6709223 ] [ 4.4906529 -2.3752629 -0.3926851 ] [ -8.3650648 -4.6245855 2.6996146 ] [ 4.7069471 10.6082136 -0.3570296 ] [ -5.1137751 12.4539443 -1.3992596 ] [ 1.9040966 -17.5871094 -1.9203257 ] [ -0.0725175 -0.4971144 -0.3012369 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.924789102432562e-09 3.239463820721198e-09 2.677112644233364e-09 ] [ 7.19481908850772e-09 -3.805590686633609e-09 -6.291508865565102e-10 ] [ -1.340231125403703e-08 -7.409402768990679e-09 4.325259397290343e-09 ] [ 7.541360598962358e-09 1.69962318183726e-08 -5.720244780535757e-10 ] [ -8.193170909249182e-09 1.995341839420542e-08 -2.24186101754996e-09 ] [ 3.050699056264769e-09 -2.817765550813191e-08 -3.076700940861394e-09 ] [ -1.16185843098864e-10 -7.964650695430196e-10 -4.826347185022674e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -5.4599796 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.747851665164936e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.1608016 2.0599616 1.5771706 ] [ 1.3211686 5.4044079 1.1305811 ] [ 3.1886213 4.259554 1.3830418 ] [ 4.0132586 0.4029203 2.7478078 ] [ 6.8252836 0.8773196 5.880158 ] [ 5.4062115 0.0694648 4.4168779 ] [ 5.1152389 5.2842759 1.6782554 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1608016e-10 2.0599616e-10 1.5771706e-10 ] [ 1.3211686e-10 5.404407900000001e-10 1.1305811e-10 ] [ 3.1886213e-10 4.259554e-10 1.3830418e-10 ] [ 4.013258600000001e-10 4.029203e-11 2.7478078e-10 ] [ 6.8252836e-10 8.773196e-11 5.880158e-10 ] [ 5.406211500000001e-10 6.94648e-12 4.4168779e-10 ] [ 5.1152389e-10 5.2842759e-10 1.6782554e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0353912 0.3013954 -0.0801805 ] [ 0.0246723 -0.0185885 -0.0404599 ] [ -0.427566 -0.3814667 -0.0028161 ] [ -0.0754618 -0.0005997 -0.0801076 ] [ 0.1333474 -0.0025434 0.1537105 ] [ 0.0304573 -0.1224744 0.04307 ] [ 0.3499419 0.2242772 0.0067836 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.670295322205696e-11 4.828886634966643e-10 -1.284633225440544e-10 ] [ 3.952938224136384e-11 -2.97820601157408e-11 -6.482390585990592e-11 ] [ -6.850362490489729e-10 -6.111770283537273e-10 -4.51188958183488e-12 ] [ -1.209031317234855e-10 -9.608253194937602e-13 -1.283465238683981e-10 ] [ 2.136460867244659e-10 -4.07497601734272e-12 2.462713694714784e-10 ] [ 4.879797399269184e-11 -1.962256203265075e-10 6.9005747057856e-11 ] [ 5.606687308183316e-10 3.593316864184858e-10 1.086852532485888e-11 ] ] } "relaxed-potential-energy" { "source-value" -15.655767 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.508330386809216e-18 } }